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Target
Chymotrypsinogen A
Ligand
BDBM50199883
Substrate
n/a
Meas. Tech.
ChEMBL_1754206 (CHEMBL4188966)
IC50
3500±n/a nM
Citation
 Goel, P; Jumpertz, T; Tichá, A; Ogorek, I; Mikles, DC; Hubalek, M; Pietrzik, CU; Strisovsky, K; Schmidt, B; Weggen, S Discovery and validation of 2-styryl substituted benzoxazin-4-ones as a novel scaffold for rhomboid protease inhibitors. Bioorg Med Chem Lett 28:1417-1422 (2018) [PubMed]  Article 
Target
Name:
Chymotrypsinogen A
Synonyms:
Alpha-chymotrypsin | CTRA_BOVIN | Chymotrypsin A | Chymotrypsin A chain A | Chymotrypsin A chain B | Chymotrypsin A chain C | Chymotrypsinogen A | alpha-Chymotrypsin (α-Chymotrypsin)
Type:
Serine protease
Mol. Mass.:
25670.88
Organism:
Bos taurus (bovine)
Description:
n/a
Residue:
245
Sequence:
CGVPAIQPVLSGLSRIVNGEEAVPGSWPWQVSLQDKTGFHFCGGSLINENWVVTAAHCGVTTSDVVVAGEFDQGSSSEKIQKLKIAKVFKNSKYNSLTINNDITLLKLSTAASFSQTVSAVCLPSASDDFAAGTTCVTTGWGLTRYTNANTPDRLQQASLPLLSNTNCKKYWGTKIKDAMICAGASGVSSCMGDSGGPLVCKKNGAWTLVGIVSWGSSTCSTSTPGVYARVTALVNWVQQTLAAN
  
Inhibitor
Name:
BDBM50199883
Synonyms:
3,4‐Dichloroisocoumarin (2) | 3,4-Dichloro-isochromen-1-one | 3,4-dichloro-1H-isochromen-1-one | 3,4-dichloroisocoumarin | CHEMBL24983 | cid_1609
Type:
Small organic molecule
Emp. Form.:
C9H4Cl2O2
Mol. Mass.:
215.033
SMILES:
Clc1oc(=O)c2ccccc2c1Cl
Structure:
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